{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.44445 0 0 ] "si-unit" "m" "si-value" [ 5.44445e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.167308 5.39053 0 ] "si-unit" "m" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00577721 0.0671422 5.23553 ] "si-unit" "m" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3643748 -0.424623 4.886583 ] [ -1.3115632 2.6953932 -4.2158713 ] [ -0.5318182 0.1220975 1.962277 ] [ -4.4125228 2.5418203 -7.2277706 ] [ 0.4717822 -2.2342537 2.553187 ] [ 0.456433 0.9644295 -3.1766029 ] [ 2.6561892 -6.1128795 5.0836972 ] [ 3.0358746 2.4480156 0.1345006 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.837927857686758e-10 -6.803210432539584e-10 7.829169038198725e-09 ] [ -2.101355895741634e-09 4.318495968903298e-09 -6.754570433161702e-09 ] [ -8.520666865559387e-10 1.95621759958128e-10 3.143914332933562e-09 ] [ -7.069640868906954e-09 4.072445058934842e-09 -1.158016507582559e-08 ] [ 7.558784109495897e-10 -3.579669043075897e-09 4.09065651993049e-09 ] [ 7.312862815616064e-10 1.545186397309834e-09 -5.08947889994548e-09 ] [ 4.255684236661456e-09 -9.793912620667594e-09 8.144980801066421e-09 ] [ 4.864007307800552e-09 3.922153361673684e-09 2.154937168035725e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.195943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.235746770960942e-18 } }